SCHEMBL689646

SCHEMBL689646

O=[C]C([C]=O)([C]=O)[C]=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29030247 0.71
SCHEMBL2466 0.59
SCHEMBL4930182 0.59
SCHEMBL1382 0.59
SCHEMBL2618 0.59
SCHEMBL1255076 0.59
SCHEMBL855112 0.59
SCHEMBL5860210 0.56
SCHEMBL7074362 0.56
Carbon Dioxide SCHEMBL6317227 0.54

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10604673-B2 Blocked polyisocyanate composition, one-component coating composition, coating film, and coated article ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-03-31 US claimed
EP-3348593-B1 BLOCKED POLYISOCYANATE COMPOSITION, ONE-COMPONENT COATING COMPOSITION, COATING FILM, AND COATED ARTICLE ASAHI CHEMICAL IND (JP) 2019-08-21 EP claimed
US-20180282574-A1 BLOCKED POLYISOCYANATE COMPOSITION, ONE-COMPONENT COATING COMPOSITION, COATING FILM, AND COATED ARTICLE ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-10-04 US claimed
EP-3348593-A1 BLOCK POLYISOCYANATE COMPOSITION, ONE-PACK COATING COMPOSITION, COATING FILM, AND COATED ARTICLE Asahi Kasei Kabushiki Kaisha (JP) 2018-07-18 EP claimed
CN-111183167-B Blocked polyisocyanate composition and use thereof 旭化成株式会社 2022-07-19 CN disclosed
EP-3712188-B1 POLYISOCYANATE COMPOSITION, BLOCKED POLYISOCYANATE COMPOSITION, COATING MATERIAL COMPOSITION, AND COATING FILM ASAHI CHEMICAL IND (JP) 2022-05-11 EP disclosed
CN-111690114-B Polyisocyanate composition, blocked polyisocyanate composition, coating composition and coating film 旭化成株式会社 2022-03-22 CN disclosed
CN-107922584-B Blocked polyisocyanate composition, one-pack type coating composition, coating film, and coated article 旭化成株式会社 2020-11-27 CN disclosed
EP-3712188-A1 POLYISOCYANATE COMPOSITION, BLOCKED POLYISOCYANATE COMPOSITION, COATING MATERIAL COMPOSITION, AND COATING FILM Asahi Kasei Kabushiki Kaisha (JP) 2020-09-23 EP disclosed
CN-111690114-A Polyisocyanate composition, blocked polyisocyanate composition, coating composition and coating film 旭化成株式会社 2020-09-22 CN disclosed
CN-111183167-A Blocked polyisocyanate composition and use thereof 旭化成株式会社 2020-05-19 CN disclosed
US-10604673-B2 Blocked polyisocyanate composition, one-component coating composition, coating film, and coated article ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-03-31 US disclosed
EP-3348593-B1 BLOCKED POLYISOCYANATE COMPOSITION, ONE-COMPONENT COATING COMPOSITION, COATING FILM, AND COATED ARTICLE ASAHI CHEMICAL IND (JP) 2019-08-21 EP disclosed
US-20180282574-A1 BLOCKED POLYISOCYANATE COMPOSITION, ONE-COMPONENT COATING COMPOSITION, COATING FILM, AND COATED ARTICLE ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-10-04 US disclosed
EP-3348593-A1 BLOCK POLYISOCYANATE COMPOSITION, ONE-PACK COATING COMPOSITION, COATING FILM, AND COATED ARTICLE Asahi Kasei Kabushiki Kaisha (JP) 2018-07-18 EP disclosed
US-8377192-B2 Stabilisers for inanimate organic materials BASF SE (DE) 2013-02-19 US disclosed
EP-2450400-A2 Stabilisers for inanimate organic materials BASF SE (DE) 2012-05-09 EP disclosed
EP-2318454-B1 STABILISERS FOR INANIMATE ORGANIC MATERIALS BASF SE (DE) 2012-02-29 EP disclosed
US-20110214590-A1 STABILISERS FOR INANIMATE ORGANIC MATERIALS BASF SE (DE) 2011-09-08 US disclosed